==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-FEB-08 2ZJA . COMPND 2 MOLECULE: PUTATIVE SKI2-TYPE HELICASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR T.OYAMA,H.OKA,R.FUJIKANE,Y.ISHINO,K.MORIKAWA . 700 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30209.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 526 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 42 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 268 38.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 3 0 2 5 5 3 1 1 2 2 1 3 0 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 7 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 53 0, 0.0 23,-4.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 163.4 -0.7 18.9 47.0 2 2 A R B > -A 23 0A 50 21,-0.3 4,-0.7 1,-0.1 3,-0.4 -0.532 360.0-116.1 -88.4 155.5 2.7 18.5 48.7 3 3 A V T >4 S+ 0 0 1 19,-3.1 3,-3.1 1,-0.2 20,-0.1 0.962 111.3 51.4 -50.8 -65.8 4.8 15.3 48.9 4 4 A D T 34 S+ 0 0 69 1,-0.3 -1,-0.2 18,-0.3 4,-0.2 0.739 97.1 68.0 -47.0 -32.8 4.7 14.8 52.7 5 5 A E T 34 S+ 0 0 120 -3,-0.4 2,-0.5 2,-0.1 -1,-0.3 0.797 76.8 105.7 -59.2 -24.4 0.9 15.2 52.7 6 6 A L S << S- 0 0 2 -3,-3.1 2,-2.8 -4,-0.7 7,-0.1 -0.370 75.5-138.5 -62.3 110.1 0.9 11.8 50.9 7 7 A R + 0 0 84 -2,-0.5 2,-0.3 3,-0.0 -1,-0.1 -0.432 63.2 116.3 -72.9 74.3 -0.2 9.3 53.5 8 8 A V S S- 0 0 12 -2,-2.8 5,-0.1 -4,-0.2 51,-0.0 -0.890 77.4 -57.2-135.2 169.0 2.4 6.7 52.3 9 9 A D >> - 0 0 40 -2,-0.3 3,-2.4 1,-0.2 4,-1.0 -0.204 50.9-124.4 -51.8 129.5 5.5 5.0 53.7 10 10 A E H 3> S+ 0 0 109 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.715 106.0 65.7 -47.9 -31.1 8.0 7.6 54.8 11 11 A R H 3> S+ 0 0 112 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.747 98.5 53.2 -67.5 -25.9 10.8 6.2 52.7 12 12 A I H <> S+ 0 0 0 -3,-2.4 4,-2.3 2,-0.2 5,-0.2 0.952 105.7 53.0 -71.5 -51.0 8.9 7.1 49.5 13 13 A K H X S+ 0 0 25 -4,-1.0 4,-1.1 1,-0.2 -2,-0.2 0.867 108.9 51.5 -50.2 -42.9 8.5 10.8 50.6 14 14 A S H >X S+ 0 0 67 -4,-1.7 4,-2.7 1,-0.2 3,-0.5 0.924 108.4 49.2 -62.7 -46.6 12.2 10.9 51.2 15 15 A T H 3X S+ 0 0 3 -4,-1.5 4,-1.2 1,-0.2 -2,-0.2 0.881 105.9 57.9 -61.7 -40.4 13.1 9.6 47.7 16 16 A L H 3X>S+ 0 0 0 -4,-2.3 5,-2.6 2,-0.2 4,-2.2 0.807 111.2 42.4 -60.3 -33.4 10.8 12.1 46.0 17 17 A K H <<5S+ 0 0 76 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.919 107.4 57.3 -80.0 -45.3 12.7 14.9 47.6 18 18 A E H <5S+ 0 0 73 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.770 112.6 47.6 -55.9 -21.4 16.1 13.5 47.0 19 19 A R H <5S- 0 0 74 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.963 125.5 -98.2 -79.6 -71.1 14.8 13.6 43.4 20 20 A G T <5S+ 0 0 58 -4,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.298 78.1 126.2 163.5 3.1 13.5 17.1 43.3 21 21 A I < + 0 0 42 -5,-2.6 -1,-0.2 1,-0.2 -2,-0.2 -0.726 12.7 154.3 -90.8 129.7 9.7 16.8 43.9 22 22 A E + 0 0 122 -2,-0.4 -19,-3.1 1,-0.4 2,-0.3 0.595 69.5 23.1-117.9 -33.8 8.2 18.8 46.7 23 23 A S B S-A 2 0A 75 -21,-0.3 -1,-0.4 -20,-0.1 -21,-0.3 -0.968 73.7-116.8-138.9 159.7 4.6 19.0 45.3 24 24 A F - 0 0 8 -23,-4.3 27,-0.1 -2,-0.3 -3,-0.0 -0.630 25.0-114.9 -99.9 147.3 2.2 17.3 43.0 25 25 A Y >> - 0 0 80 -2,-0.3 4,-2.5 25,-0.2 3,-0.5 -0.471 39.9-107.4 -71.1 145.4 0.5 18.4 39.7 26 26 A P H 3> S+ 0 0 65 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.891 121.2 51.5 -43.0 -49.9 -3.3 18.6 40.1 27 27 A P H 3> S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.920 111.7 48.3 -54.9 -45.1 -3.8 15.4 38.0 28 28 A Q H <> S+ 0 0 7 -3,-0.5 4,-3.5 22,-0.3 5,-0.2 0.933 111.1 48.9 -59.6 -50.6 -1.3 13.6 40.1 29 29 A A H X S+ 0 0 11 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.975 111.3 50.0 -53.5 -56.8 -2.9 14.7 43.4 30 30 A E H < S+ 0 0 98 -4,-2.9 3,-0.4 1,-0.3 -1,-0.2 0.879 115.8 43.7 -48.5 -45.7 -6.3 13.7 42.1 31 31 A A H ><>S+ 0 0 0 -4,-2.5 3,-1.7 -5,-0.2 5,-0.6 0.888 109.2 54.8 -69.3 -42.6 -4.9 10.3 41.1 32 32 A L H 3<5S+ 0 0 0 -4,-3.5 5,-0.3 1,-0.3 -1,-0.2 0.659 115.8 40.3 -68.0 -15.1 -2.9 9.8 44.3 33 33 A K T 3<5S+ 0 0 131 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.016 88.7 95.4-119.1 22.7 -6.1 10.3 46.3 34 34 A S T < 5S- 0 0 24 -3,-1.7 -2,-0.1 -5,-0.1 -3,-0.1 0.807 111.1 -90.5 -81.3 -32.3 -8.3 8.3 44.0 35 35 A G T > >S+ 0 0 3 -4,-0.5 5,-2.0 5,-0.1 3,-0.6 0.305 96.7 118.0 135.1 1.1 -8.0 5.2 46.0 36 36 A I G > - 0 0 15 0, 0.0 3,-1.6 0, 0.0 5,-0.1 -0.184 43.2-118.4 -51.8 146.9 -1.1 14.5 29.2 48 48 A T G > S+ 0 0 73 1,-0.3 3,-0.8 2,-0.2 4,-0.2 0.643 112.2 66.1 -67.2 -12.1 2.4 13.0 29.3 49 49 A A G 3 S+ 0 0 37 1,-0.2 -1,-0.3 318,-0.1 150,-0.1 0.804 89.4 72.3 -77.1 -20.6 3.8 16.3 30.5 50 50 A S G < S- 0 0 0 -3,-1.6 -22,-0.3 148,-0.2 -1,-0.2 0.337 110.8-104.9 -78.2 3.3 1.8 15.8 33.7 51 51 A G <> + 0 0 20 -3,-0.8 4,-1.1 -4,-0.1 -3,-0.1 0.956 50.9 164.9 76.1 58.0 3.8 12.9 35.3 52 52 A K H > S+ 0 0 9 -4,-0.2 4,-1.8 2,-0.2 3,-0.2 0.907 75.4 57.9 -69.6 -40.3 1.9 9.6 35.0 53 53 A T H > S+ 0 0 30 1,-0.2 4,-2.7 2,-0.2 3,-0.3 0.939 100.6 54.9 -54.6 -55.2 5.0 7.6 35.9 54 54 A L H > S+ 0 0 19 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.882 106.7 52.2 -46.3 -46.4 5.5 9.2 39.3 55 55 A I H X S+ 0 0 0 -4,-1.1 4,-2.4 1,-0.2 -1,-0.3 0.918 111.1 47.8 -57.2 -45.5 1.9 8.3 40.2 56 56 A A H X S+ 0 0 0 -4,-1.8 4,-3.1 -3,-0.3 -2,-0.2 0.898 111.9 49.0 -63.8 -44.1 2.6 4.7 39.3 57 57 A E H X S+ 0 0 5 -4,-2.7 4,-2.9 2,-0.2 5,-0.4 0.952 111.7 47.4 -61.7 -53.2 5.8 4.5 41.2 58 58 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.957 116.6 45.6 -52.8 -48.4 4.4 5.9 44.4 59 59 A A H X S+ 0 0 1 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.877 116.2 45.7 -60.9 -45.1 1.4 3.5 44.0 60 60 A M H X S+ 0 0 0 -4,-3.1 4,-2.4 2,-0.2 -2,-0.2 0.979 115.3 43.3 -62.0 -63.5 3.7 0.5 43.2 61 61 A V H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 5,-0.3 0.878 114.3 53.0 -52.7 -41.4 6.3 1.1 46.0 62 62 A H H >X S+ 0 0 21 -4,-2.4 4,-3.0 -5,-0.4 3,-0.5 0.984 109.0 47.1 -57.2 -62.4 3.5 1.8 48.5 63 63 A R H 3X S+ 0 0 46 -4,-2.2 4,-1.1 1,-0.3 -1,-0.2 0.840 115.4 48.9 -47.0 -41.2 1.6 -1.4 47.7 64 64 A I H 3X S+ 0 0 6 -4,-2.4 4,-1.4 2,-0.2 -1,-0.3 0.851 113.5 41.6 -73.5 -37.7 4.9 -3.3 47.9 65 65 A L H << S+ 0 0 43 -4,-2.5 -2,-0.2 -3,-0.5 -1,-0.2 0.842 119.2 45.7 -79.1 -33.4 6.2 -1.9 51.2 66 66 A T H < S+ 0 0 67 -4,-3.0 -2,-0.2 -5,-0.3 -1,-0.2 0.646 134.5 14.4 -84.1 -14.8 2.7 -2.1 52.9 67 67 A Q H < S- 0 0 110 -4,-1.1 -2,-0.2 -5,-0.3 -3,-0.2 0.313 98.4-131.6-141.4 10.4 1.9 -5.6 51.7 68 68 A G < + 0 0 33 -4,-1.4 2,-0.2 1,-0.1 -1,-0.1 -0.016 58.8 87.4 62.1-176.1 5.2 -7.0 50.4 69 69 A G S S- 0 0 25 70,-0.1 2,-0.3 -4,-0.1 70,-0.2 -0.571 75.7 -45.1 95.6-154.6 5.5 -8.8 47.1 70 70 A K E -d 139 0B 8 68,-1.3 70,-2.3 -2,-0.2 71,-1.2 -0.877 30.7-149.3-126.2 154.9 6.3 -7.5 43.6 71 71 A A E -de 141 117B 0 45,-1.7 47,-1.9 -2,-0.3 2,-0.6 -0.996 16.7-152.3-124.4 120.0 5.2 -4.7 41.4 72 72 A V E -de 142 118B 0 69,-3.3 71,-3.2 -2,-0.5 2,-0.6 -0.865 5.3-162.3 -99.9 119.6 5.2 -5.3 37.6 73 73 A Y E -de 143 119B 0 45,-2.6 47,-1.7 -2,-0.6 2,-0.7 -0.882 6.8-154.4-104.1 117.2 5.6 -2.3 35.3 74 74 A I E -de 144 120B 3 69,-3.3 71,-2.5 -2,-0.6 47,-0.2 -0.805 13.8-178.3 -98.1 113.5 4.6 -2.9 31.7 75 75 A V E - e 0 121B 2 45,-1.6 47,-0.6 -2,-0.7 6,-0.1 -0.700 31.7-122.1-103.9 156.5 6.3 -0.8 29.0 76 76 A P S S+ 0 0 22 0, 0.0 2,-0.3 0, 0.0 46,-0.2 0.892 87.5 19.2 -64.7 -47.0 5.6 -0.8 25.2 77 77 A L S > S- 0 0 56 1,-0.1 3,-1.1 44,-0.1 4,-0.1 -0.899 73.6-116.7-130.1 157.2 9.0 -1.7 23.9 78 78 A K T >> S+ 0 0 73 -2,-0.3 3,-2.8 1,-0.3 4,-0.9 0.891 113.7 61.6 -55.1 -46.7 12.3 -3.2 25.2 79 79 A A H 3> S+ 0 0 43 1,-0.3 4,-0.8 2,-0.2 -1,-0.3 0.766 102.9 51.4 -52.6 -29.1 14.1 0.0 24.5 80 80 A L H <> S+ 0 0 33 -3,-1.1 4,-1.0 2,-0.2 -1,-0.3 0.360 94.1 73.1 -90.2 2.3 11.8 1.7 27.0 81 81 A A H <> S+ 0 0 0 -3,-2.8 4,-2.9 2,-0.2 -2,-0.2 0.921 96.4 50.1 -77.3 -45.0 12.6 -0.9 29.6 82 82 A E H X S+ 0 0 59 -4,-0.9 4,-2.7 2,-0.2 5,-0.2 0.899 107.7 51.0 -58.0 -51.4 16.1 0.6 30.2 83 83 A E H X S+ 0 0 62 -4,-0.8 4,-2.5 1,-0.2 -1,-0.2 0.925 116.0 42.8 -55.4 -46.0 14.9 4.2 30.6 84 84 A K H X S+ 0 0 21 -4,-1.0 4,-0.7 1,-0.2 -2,-0.2 0.902 110.8 56.9 -67.4 -39.0 12.4 3.0 33.2 85 85 A F H < S+ 0 0 43 -4,-2.9 4,-0.5 2,-0.2 3,-0.4 0.889 111.3 43.1 -57.8 -44.7 15.0 0.7 34.7 86 86 A Q H >< S+ 0 0 98 -4,-2.7 3,-1.9 1,-0.2 4,-0.4 0.973 112.1 50.0 -67.8 -56.1 17.3 3.7 35.3 87 87 A E H 3< S+ 0 0 64 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.535 111.5 52.1 -64.0 -1.2 14.7 6.1 36.6 88 88 A F T >< S+ 0 0 0 -4,-0.7 3,-2.1 -3,-0.4 -1,-0.3 0.528 83.3 93.4-105.3 -13.9 13.6 3.4 39.0 89 89 A Q G X + 0 0 51 -3,-1.9 3,-3.1 -4,-0.5 4,-0.5 0.864 68.8 69.7 -47.7 -46.3 17.1 2.8 40.4 90 90 A D G 3 S+ 0 0 36 -4,-0.4 3,-0.5 1,-0.3 4,-0.4 0.674 85.8 71.4 -53.7 -13.6 16.8 5.2 43.3 91 91 A W G < >S+ 0 0 0 -3,-2.1 5,-1.7 1,-0.2 -1,-0.3 0.505 83.0 69.8 -77.8 -8.2 14.3 2.7 44.8 92 92 A E T X 5S+ 0 0 69 -3,-3.1 3,-2.8 3,-0.2 -1,-0.2 0.869 86.7 67.3 -73.5 -37.8 17.2 0.3 45.5 93 93 A K T 3 5S+ 0 0 135 -4,-0.5 -1,-0.2 -3,-0.5 -2,-0.2 0.838 101.4 47.3 -50.4 -39.5 18.4 2.8 48.1 94 94 A I T 3 5S- 0 0 31 -4,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.134 131.0 -90.3 -92.3 21.4 15.3 2.0 50.2 95 95 A G T < 5S+ 0 0 53 -3,-2.8 2,-0.7 1,-0.2 -3,-0.2 0.261 85.0 128.4 96.8 -14.9 15.7 -1.8 49.9 96 96 A L < - 0 0 8 -5,-1.7 2,-0.4 20,-0.1 -1,-0.2 -0.697 48.5-146.2 -85.4 114.9 13.6 -2.5 46.7 97 97 A R - 0 0 108 -2,-0.7 19,-2.4 17,-0.1 20,-1.4 -0.635 16.1-157.1 -79.9 130.4 15.6 -4.6 44.1 98 98 A V E +f 117 0B 4 -2,-0.4 2,-0.3 18,-0.2 20,-0.2 -0.836 13.4 176.7-112.0 146.5 14.7 -3.7 40.5 99 99 A A E -f 118 0B 4 18,-2.2 20,-2.7 -2,-0.3 2,-0.3 -0.977 22.3-130.7-146.9 159.8 15.1 -5.8 37.3 100 100 A M E +f 119 0B 74 -2,-0.3 2,-0.3 18,-0.2 20,-0.2 -0.849 17.6 178.0-109.9 149.5 14.4 -5.8 33.6 101 101 A A E +f 120 0B 5 18,-2.4 20,-0.9 -2,-0.3 23,-0.1 -0.850 24.9 134.2-151.5 104.7 12.8 -8.6 31.6 102 102 A T + 0 0 32 -2,-0.3 2,-0.2 18,-0.2 22,-0.2 0.596 65.6 17.5-129.7 -20.3 12.2 -8.1 27.8 103 103 A G S S+ 0 0 14 1,-0.1 18,-0.0 20,-0.1 0, 0.0 -0.535 75.1 83.3-133.3-157.2 13.3 -11.2 25.9 104 104 A D + 0 0 117 -2,-0.2 3,-0.3 2,-0.1 -1,-0.1 0.978 46.8 177.6 52.3 62.3 14.1 -14.9 26.4 105 105 A Y + 0 0 29 1,-0.2 2,-2.7 384,-0.2 385,-0.2 0.912 66.3 73.5 -61.9 -39.5 10.4 -15.9 26.2 106 106 A D S S+ 0 0 26 383,-0.3 2,-0.3 2,-0.0 -1,-0.2 -0.200 88.4 78.8 -74.3 53.6 11.3 -19.6 26.6 107 107 A S - 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0 0 44 -4,-0.2 -3,-0.2 -5,-0.2 -4,-0.1 0.821 24.7-156.3 56.9 39.4 3.9 -20.3 35.1 133 133 A S > < - 0 0 2 -5,-1.7 3,-1.9 1,-0.1 4,-0.4 -0.127 18.0-127.0 -48.6 135.9 6.8 -18.8 37.1 134 134 A S T 3 S+ 0 0 61 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.664 105.9 60.4 -60.6 -21.7 6.5 -19.3 40.9 135 135 A W T > S+ 0 0 2 1,-0.2 3,-0.8 2,-0.1 4,-0.4 0.526 81.7 84.5 -86.8 -3.5 7.0 -15.6 41.6 136 136 A I G X S+ 0 0 10 -3,-1.9 3,-1.8 1,-0.3 -1,-0.2 0.910 84.5 54.9 -65.8 -42.2 3.9 -14.6 39.6 137 137 A K G 3 S+ 0 0 148 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.683 98.3 69.5 -64.6 -12.9 1.4 -15.2 42.4 138 138 A D G < S+ 0 0 67 -3,-0.8 -68,-1.3 -4,-0.1 -1,-0.3 0.731 75.0 105.4 -74.1 -25.7 3.7 -12.8 44.4 139 139 A V E < +d 70 0B 4 -3,-1.8 -68,-0.2 -4,-0.4 3,-0.1 -0.421 38.3 173.0 -65.9 124.0 2.7 -9.8 42.3 140 140 A K E + 0 0 68 -70,-2.3 31,-3.4 1,-0.3 2,-0.3 0.587 68.5 24.0-101.9 -21.1 0.3 -7.4 44.0 141 141 A I E -dg 71 171B 0 -71,-1.2 -69,-3.3 29,-0.2 2,-0.4 -0.997 53.8-170.2-153.0 143.0 0.3 -4.7 41.3 142 142 A L E -dg 72 172B 0 29,-2.5 31,-1.9 -2,-0.3 2,-0.6 -0.999 13.3-153.0-132.5 127.2 0.9 -4.3 37.6 143 143 A V E -dg 73 173B 0 -71,-3.2 -69,-3.3 -2,-0.4 2,-0.9 -0.915 4.7-154.9-105.3 115.2 1.1 -1.0 35.9 144 144 A A E > -dg 74 174B 0 29,-2.4 31,-2.7 -2,-0.6 3,-0.7 -0.801 16.5-159.6 -87.7 104.0 0.1 -0.9 32.2 145 145 A D E 3 S+ g 0 175B 19 -71,-2.5 31,-0.1 -2,-0.9 4,-0.1 -0.653 74.3 11.3 -85.4 145.7 2.0 2.0 30.8 146 146 A E T > S+ 0 0 39 29,-1.1 3,-2.1 -2,-0.3 -1,-0.3 0.903 80.2 172.7 53.6 44.4 0.7 3.5 27.5 147 147 A I G X + 0 0 0 28,-1.9 3,-1.4 -3,-0.7 29,-0.2 0.570 61.7 77.8 -61.5 -12.9 -2.4 1.4 28.0 148 148 A H G > S+ 0 0 10 27,-0.3 3,-2.4 1,-0.3 -1,-0.3 0.704 74.1 80.1 -71.0 -17.0 -4.2 3.0 25.1 149 149 A L G X + 0 0 60 -3,-2.1 3,-1.9 1,-0.3 -1,-0.3 0.528 68.4 86.0 -65.1 -3.9 -2.0 0.8 22.9 150 150 A I G < S+ 0 0 0 -3,-1.4 257,-0.6 1,-0.3 -1,-0.3 0.827 86.1 53.7 -66.2 -26.1 -4.6 -1.8 23.9 151 151 A G G < S+ 0 0 24 -3,-2.4 2,-0.5 255,-0.1 -1,-0.3 0.287 88.3 109.9 -88.9 10.3 -6.4 -0.4 20.9 152 152 A S <> - 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0 0 23 -3,-1.2 4,-3.2 1,-0.2 5,-0.3 -0.679 54.6-155.5 -77.0 105.5 -6.1 -10.5 15.5 411 411 A E H > S+ 0 0 46 -2,-1.0 4,-2.7 1,-0.2 5,-0.3 0.885 91.0 56.3 -46.3 -44.9 -5.9 -14.0 14.1 412 412 A S H > S+ 0 0 40 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.945 115.6 30.7 -54.7 -62.6 -2.2 -13.9 14.8 413 413 A N H > S+ 0 0 27 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.818 121.0 55.7 -69.7 -28.6 -2.2 -13.1 18.5 414 414 A L H X S+ 0 0 4 -4,-3.2 4,-2.1 2,-0.2 -2,-0.2 0.810 105.7 49.0 -73.7 -33.7 -5.4 -15.0 18.9 415 415 A R H X S+ 0 0 52 -4,-2.7 4,-1.9 -5,-0.3 5,-0.2 0.967 115.4 46.1 -68.8 -45.6 -4.0 -18.2 17.4 416 416 A S H X S+ 0 0 10 -4,-1.9 4,-1.2 -5,-0.3 -2,-0.2 0.828 116.5 44.9 -61.9 -36.2 -1.1 -17.8 19.7 417 417 A Q H X S+ 0 0 5 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.749 107.9 54.5 -83.3 -28.3 -3.4 -17.0 22.7 418 418 A V H X S+ 0 0 1 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.899 112.2 45.8 -72.0 -38.6 -6.0 -19.8 22.1 419 419 A L H X S+ 0 0 0 -4,-1.9 4,-4.1 -5,-0.2 5,-0.3 0.872 110.6 54.0 -69.9 -38.7 -3.2 -22.4 22.1 420 420 A A H X>S+ 0 0 0 -4,-1.2 4,-3.2 1,-0.2 5,-1.3 0.937 102.5 56.4 -61.0 -47.8 -1.6 -20.8 25.2 421 421 A L H <5S+ 0 0 3 -4,-2.1 6,-2.2 3,-0.2 -1,-0.2 0.825 120.4 32.0 -53.3 -32.0 -4.9 -21.0 27.1 422 422 A I H <5S+ 0 0 3 -4,-0.9 4,-0.4 -3,-0.3 -2,-0.2 0.884 124.1 42.8 -91.4 -47.9 -4.8 -24.8 26.4 423 423 A A H <5S+ 0 0 10 -4,-4.1 -3,-0.2 60,-0.1 -2,-0.2 0.726 134.4 11.9 -74.3 -23.3 -1.1 -25.5 26.4 424 424 A T T <5S+ 0 0 32 -4,-3.2 -3,-0.2 -5,-0.3 -1,-0.1 0.567 128.2 43.6-132.3 -13.2 -0.2 -23.4 29.4 425 425 A F S > S- 0 0 27 47,-0.2 4,-1.2 1,-0.1 3,-0.8 -0.961 71.7-132.6-128.4 147.4 -13.4 -27.3 26.7 430 430 A V H 3> S+ 0 0 19 -2,-0.3 4,-1.3 1,-0.2 5,-0.2 0.861 109.2 64.5 -64.7 -32.0 -14.6 -24.7 24.2 431 431 A E H 34 S+ 0 0 147 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.776 103.1 48.4 -60.9 -26.4 -17.1 -23.5 26.8 432 432 A E H X> S+ 0 0 78 -3,-0.8 4,-1.5 2,-0.2 3,-0.6 0.825 103.6 57.0 -82.8 -38.8 -14.1 -22.5 29.0 433 433 A I H 3X S+ 0 0 0 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.752 108.0 50.4 -64.2 -24.8 -12.2 -20.6 26.3 434 434 A L H 3X S+ 0 0 32 -4,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.611 101.9 60.9 -88.0 -15.2 -15.4 -18.4 25.9 435 435 A K H <> S+ 0 0 133 -3,-0.6 4,-0.5 -4,-0.3 -2,-0.2 0.874 107.8 44.6 -74.6 -41.0 -15.6 -17.8 29.6 436 436 A F H >< S+ 0 0 17 -4,-1.5 3,-2.3 1,-0.2 -2,-0.2 0.985 114.6 48.9 -62.6 -57.1 -12.1 -16.2 29.5 437 437 A I H >< S+ 0 0 5 -4,-1.7 3,-1.7 1,-0.3 6,-0.6 0.777 101.7 63.0 -53.3 -32.8 -13.2 -14.3 26.4 438 438 A S H 3< S+ 0 0 50 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.714 105.0 48.8 -68.5 -17.9 -16.4 -13.1 28.0 439 439 A N T << S+ 0 0 103 -3,-2.3 -1,-0.3 -4,-0.5 -2,-0.2 0.155 93.7 101.6-104.1 13.0 -14.2 -11.3 30.5 440 440 A T S <> S- 0 0 1 -3,-1.7 4,-0.9 1,-0.1 -279,-0.1 -0.427 86.0-110.1 -91.3 171.8 -12.0 -9.6 27.9 441 441 A F H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.836 117.5 62.0 -70.2 -32.0 -12.2 -6.0 26.8 442 442 A Y H > S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.967 107.5 42.1 -55.5 -55.2 -13.5 -7.3 23.4 443 443 A A H 4 S+ 0 0 20 -6,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.672 109.7 60.6 -66.3 -20.1 -16.6 -8.8 25.1 444 444 A Y H < S+ 0 0 95 -4,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.959 109.5 39.0 -72.4 -49.9 -17.0 -5.7 27.3 445 445 A Q H < S+ 0 0 38 -4,-2.2 -2,-0.2 -3,-0.1 -1,-0.1 0.853 109.3 77.8 -67.4 -37.4 -17.5 -3.3 24.4 446 446 A R < - 0 0 111 -4,-2.0 3,-0.1 -5,-0.3 0, 0.0 -0.325 65.6-150.5 -79.2 156.7 -19.6 -5.8 22.4 447 447 A K S S+ 0 0 195 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.764 93.4 9.2 -87.7 -31.5 -23.2 -6.8 22.9 448 448 A D - 0 0 67 -3,-0.0 -1,-0.3 1,-0.0 3,-0.1 -0.981 52.6-159.7-145.8 156.1 -22.2 -10.2 21.4 449 449 A T > + 0 0 28 -2,-0.3 4,-2.2 -3,-0.1 5,-0.2 -0.082 51.0 127.1-125.0 32.9 -18.9 -12.0 20.6 450 450 A Y H > S+ 0 0 170 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.873 73.3 51.1 -60.5 -39.0 -20.4 -14.6 18.2 451 451 A S H > S+ 0 0 90 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.900 109.5 51.5 -67.0 -37.7 -18.0 -13.7 15.3 452 452 A L H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.891 104.8 55.7 -65.8 -40.8 -15.1 -14.1 17.7 453 453 A E H X S+ 0 0 50 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.887 107.2 51.4 -59.6 -36.7 -16.3 -17.5 18.9 454 454 A E H X S+ 0 0 99 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.928 108.7 48.9 -65.5 -47.8 -16.3 -18.6 15.2 455 455 A K H X S+ 0 0 74 -4,-1.9 4,-2.5 1,-0.2 3,-0.3 0.969 111.6 51.7 -52.7 -53.1 -12.7 -17.5 14.7 456 456 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.3 -2,-0.2 0.838 108.3 50.2 -52.2 -43.6 -11.8 -19.3 17.9 457 457 A R H X S+ 0 0 94 -4,-2.1 4,-1.6 2,-0.2 -1,-0.3 0.895 111.6 47.3 -66.4 -40.0 -13.4 -22.6 16.6 458 458 A N H X S+ 0 0 100 -4,-2.3 4,-1.8 -3,-0.3 -2,-0.2 0.870 108.8 55.9 -68.7 -32.9 -11.6 -22.4 13.3 459 459 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.923 104.8 53.7 -62.5 -42.2 -8.4 -21.7 15.2 460 460 A L H X S+ 0 0 11 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.888 106.0 51.7 -60.1 -40.4 -9.0 -24.9 17.1 461 461 A Y H X S+ 0 0 150 -4,-1.6 4,-2.9 1,-0.2 -1,-0.2 0.866 109.9 50.1 -65.6 -33.8 -9.3 -26.8 13.8 462 462 A F H X S+ 0 0 28 -4,-1.8 4,-1.7 2,-0.2 6,-0.3 0.865 115.4 41.9 -69.7 -41.0 -6.0 -25.4 12.7 463 463 A L H <>S+ 0 0 0 -4,-2.2 5,-2.0 2,-0.2 6,-1.5 0.876 117.2 49.2 -73.0 -38.6 -4.3 -26.4 16.0 464 464 A L H ><5S+ 0 0 49 -4,-3.0 3,-1.1 -5,-0.2 -2,-0.2 0.940 115.4 41.4 -66.5 -49.1 -6.1 -29.7 15.9 465 465 A E H 3<5S+ 0 0 151 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.852 112.8 54.9 -71.0 -31.1 -5.2 -30.5 12.4 466 466 A N T 3<5S- 0 0 22 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.200 114.3-115.6 -88.5 17.6 -1.6 -29.2 12.8 467 467 A E T < 5S+ 0 0 115 -3,-1.1 16,-0.3 2,-0.2 15,-0.3 0.540 82.6 123.3 61.0 12.8 -1.1 -31.6 15.8 468 468 A F S - 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0 0 35 -2,-0.6 4,-2.3 -3,-0.1 5,-0.2 -0.239 61.3 -61.7-109.3-159.5 31.8 -8.3 20.2 656 656 A R H > S+ 0 0 33 -17,-0.3 4,-1.8 1,-0.2 5,-0.2 0.962 130.2 46.4 -52.4 -61.2 32.5 -9.5 16.6 657 657 A R H > S+ 0 0 199 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.886 116.8 39.9 -49.5 -57.4 35.4 -7.2 16.1 658 658 A R H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.861 111.0 58.0 -66.0 -36.7 37.3 -7.7 19.3 659 659 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.865 110.9 44.3 -60.9 -36.9 36.7 -11.4 19.4 660 660 A R H X S+ 0 0 50 -4,-1.8 4,-2.9 -5,-0.2 -1,-0.2 0.876 111.5 51.7 -74.1 -43.4 38.4 -11.7 16.0 661 661 A A H < S+ 0 0 21 -4,-2.0 4,-0.5 -5,-0.2 -2,-0.2 0.864 114.0 45.5 -62.3 -36.0 41.3 -9.4 16.9 662 662 A L H <>S+ 0 0 0 -4,-2.6 5,-2.3 2,-0.2 3,-0.4 0.917 115.4 45.3 -72.2 -45.5 41.9 -11.5 20.0 663 663 A Y H ><5S+ 0 0 47 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.863 112.3 51.0 -65.6 -41.8 41.6 -14.9 18.1 664 664 A N T 3<5S+ 0 0 109 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.617 108.5 53.9 -72.5 -13.8 43.8 -13.7 15.3 665 665 A S T 3 5S- 0 0 65 -4,-0.5 -1,-0.2 -3,-0.4 -2,-0.2 0.365 129.5 -92.3-100.4 2.4 46.4 -12.6 17.8 666 666 A G T < 5S+ 0 0 38 -3,-1.2 2,-1.4 1,-0.1 -3,-0.2 0.165 93.1 115.6 111.1 -18.8 46.5 -16.0 19.5 667 667 A F < + 0 0 28 -5,-2.3 -2,-0.1 -6,-0.2 -1,-0.1 -0.673 26.9 149.8 -88.7 88.1 44.0 -15.7 22.2 668 668 A R + 0 0 145 -2,-1.4 2,-0.2 -5,-0.1 -1,-0.2 0.637 59.2 33.4 -93.8 -19.5 41.4 -18.3 21.1 669 669 A S S > S- 0 0 38 -3,-0.2 4,-1.3 -22,-0.1 5,-0.1 -0.783 82.2-108.6-130.7 174.6 40.0 -19.4 24.5 670 670 A I H > S+ 0 0 34 -2,-0.2 4,-2.3 2,-0.2 5,-0.1 0.848 121.3 56.8 -71.5 -30.8 39.3 -18.0 28.0 671 671 A E H > S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.901 104.2 52.5 -65.1 -41.7 42.3 -20.0 29.2 672 672 A D H 4 S+ 0 0 37 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.851 109.8 48.8 -61.4 -37.6 44.5 -18.2 26.7 673 673 A I H >< S+ 0 0 0 -4,-1.3 3,-0.8 1,-0.2 -2,-0.2 0.910 109.2 52.9 -69.8 -42.1 43.2 -14.8 28.0 674 674 A S H 3< S+ 0 0 69 -4,-2.3 2,-0.7 1,-0.3 -2,-0.2 0.872 101.2 58.3 -60.2 -45.3 43.9 -15.8 31.6 675 675 A Q T 3< S+ 0 0 139 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.3 -0.081 98.1 99.3 -79.1 40.0 47.5 -16.9 31.0 676 676 A A < - 0 0 15 -3,-0.8 -3,-0.0 -2,-0.7 -4,-0.0 -0.966 67.6-131.2-139.6 148.4 48.2 -13.3 29.7 677 677 A R >> - 0 0 48 -2,-0.3 3,-1.4 1,-0.1 4,-1.2 -0.612 29.8-122.2 -87.3 146.1 49.7 -9.9 30.7 678 678 A P H 3> S+ 0 0 61 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.819 110.2 68.1 -58.3 -30.8 47.7 -6.8 29.9 679 679 A E H 3> S+ 0 0 55 1,-0.2 4,-0.5 2,-0.2 -3,-0.0 0.851 100.3 50.0 -56.6 -36.1 50.6 -5.5 27.8 680 680 A E H X4 S+ 0 0 86 -3,-1.4 3,-1.1 2,-0.2 4,-0.5 0.951 110.8 45.8 -69.2 -52.2 49.9 -8.3 25.4 681 681 A L H >< S+ 0 0 0 -4,-1.2 3,-1.3 1,-0.2 6,-0.3 0.860 107.9 57.8 -60.5 -38.6 46.1 -7.6 25.0 682 682 A L H 3< S+ 0 0 73 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.678 96.4 64.4 -68.6 -15.6 46.7 -3.8 24.6 683 683 A K T << S+ 0 0 173 -3,-1.1 2,-0.6 -4,-0.5 -1,-0.3 0.702 82.5 93.4 -78.5 -20.1 48.9 -4.5 21.6 684 684 A I S X S- 0 0 12 -3,-1.3 3,-2.2 -4,-0.5 2,-0.2 -0.665 87.9-117.6 -78.8 118.2 46.0 -5.9 19.7 685 685 A E T 3 S+ 0 0 92 -2,-0.6 3,-0.1 1,-0.3 -2,-0.1 -0.339 100.1 30.9 -58.4 115.9 44.2 -3.2 17.6 686 686 A G T 3 S+ 0 0 51 1,-0.2 2,-0.7 -2,-0.2 -1,-0.3 0.156 92.5 97.8 122.1 -21.3 40.7 -2.9 18.9 687 687 A I < - 0 0 8 -3,-2.2 -1,-0.2 -6,-0.3 2,-0.2 -0.915 55.0-175.2-102.9 109.2 41.2 -3.7 22.6 688 688 A G >> - 0 0 35 -2,-0.7 4,-1.7 -3,-0.1 3,-0.7 -0.468 42.8 -89.0 -95.9 177.5 41.6 -0.5 24.5 689 689 A V H 3> S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.864 123.9 55.5 -54.0 -42.9 42.4 0.0 28.2 690 690 A K H 3> S+ 0 0 164 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.843 107.3 50.8 -62.0 -34.2 38.7 -0.1 29.3 691 691 A T H <> S+ 0 0 2 -3,-0.7 4,-2.6 2,-0.2 -1,-0.2 0.916 108.7 49.4 -69.1 -46.9 38.2 -3.5 27.6 692 692 A V H X S+ 0 0 9 -4,-1.7 4,-3.2 2,-0.2 5,-0.3 0.874 110.9 52.2 -61.2 -36.9 41.3 -5.1 29.3 693 693 A E H X S+ 0 0 58 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.968 112.2 44.1 -65.0 -49.0 40.1 -3.8 32.6 694 694 A A H X S+ 0 0 20 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.847 115.3 50.8 -63.8 -34.0 36.7 -5.4 32.1 695 695 A I H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.971 113.9 40.2 -70.8 -53.3 38.3 -8.5 30.9 696 696 A F H < S+ 0 0 57 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.868 113.1 56.1 -64.1 -33.7 40.8 -9.0 33.8 697 697 A K H >< S+ 0 0 166 -4,-2.6 3,-1.2 -5,-0.3 -1,-0.2 0.920 108.6 49.0 -61.9 -39.9 38.1 -8.0 36.2 698 698 A F H 3< S+ 0 0 92 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.826 107.2 54.9 -67.5 -34.5 36.0 -10.8 34.7 699 699 A L T 3< 0 0 50 -4,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.267 360.0 360.0 -84.3 13.4 38.8 -13.3 35.0 700 700 A G < 0 0 100 -3,-1.2 -1,-0.1 -5,-0.1 -4,-0.1 -0.641 360.0 360.0 96.1 360.0 39.1 -12.5 38.7